3-[(3,5-dimethylphenoxy)methyl]-5-[(4-methylphenyl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazole

Systemtic Name: 3-[(3,5-dimethylphenoxy)methyl]-5-[(4-methylphenyl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazole Openeye Name: 4-allyl-3-[(3,5-dimethylphenoxy)methyl]-5-(p-tolylmethylsulfanyl)-1,2,4-triazole CAS Name: 3-[(3,5-dimethylphenoxy)methyl]-5-[(4-methylphenyl)methylthio]-4-prop-2-enyl-1,2,4-triazole IUPAC Name: 3-[(3,5-dimethylphenoxy)methyl]-5-[(4-methylphenyl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazole Traditional Name: 4-allyl-3-[(3,5-dimethylphenoxy)methyl]-5-[(4-methylbenzyl)thio]-1,2,4-triazole Formula: C22H25N3OS MolecularWeight: 379.5184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2=NN=C(N2CC=C)COC3=CC(=CC(=C3)C)C

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=NN=C(N2CC=C)COC3=CC(=CC(=C3)C)C

InChI

InChI=1S/C22H25N3OS/c1-5-10-25-21(14-26-20-12-17(3)11-18(4)13-20)23-24-22(25)27-15-19-8-6-16(2)7-9-19/h5-9,11-13H,1,10,14-15H2,2-4H3